B9EKJ4 -OEChem-04012114353D 38 40 0 0 0 0 0 0 0999 V2000 4.8696 -1.0607 0.0004 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1391 -3.3315 -0.0002 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.9084 1.3878 -0.0007 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.8576 -3.3396 -0.0010 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.2413 -0.9817 -0.0012 F 0 0 0 0 0 0 0 0 0 0 0 0 0.8129 5.1725 0.0013 F 0 0 0 0 0 0 0 0 0 0 0 0 5.3072 -1.6458 1.2597 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3313 -1.6278 -1.2592 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1122 -0.9522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3393 -0.9791 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8159 0.2550 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1237 -1.0292 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1336 1.5309 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0315 -0.9918 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0318 -0.9914 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8011 -2.1652 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4263 -1.0167 1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4264 -1.0165 -1.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 0.2409 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -2.1750 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9019 -0.9720 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8042 2.1460 -1.2076 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8054 2.1460 1.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 0.6539 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1465 3.3761 -1.2072 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1477 3.3761 1.2087 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1817 3.9911 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5028 -0.9810 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5031 -0.9806 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9485 -1.0189 2.1606 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9494 -1.0192 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0531 1.6808 -2.1586 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0552 1.6806 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9434 1.1318 0.8976 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9507 1.1306 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4329 0.7049 0.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1102 3.8552 -2.1473 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1082 3.8551 2.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 1 8 2 0 0 0 0 1 12 1 0 0 0 0 1 24 1 0 0 0 0 2 16 1 0 0 0 0 3 19 1 0 0 0 0 4 20 1 0 0 0 0 5 21 1 0 0 0 0 6 27 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 16 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 12 17 2 0 0 0 0 12 18 1 0 0 0 0 13 22 2 0 0 0 0 13 23 1 0 0 0 0 14 17 1 0 0 0 0 14 28 1 0 0 0 0 15 18 2 0 0 0 0 15 29 1 0 0 0 0 16 20 2 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 22 25 1 0 0 0 0 22 32 1 0 0 0 0 23 26 2 0 0 0 0 23 33 1 0 0 0 0 24 34 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 25 27 2 0 0 0 0 25 37 1 0 0 0 0 26 27 1 0 0 0 0 26 38 1 0 0 0 0 M END $$$$